BMMCBZ1Sj049
From Metabolomics.JP
(Redirected from INCHI:BTNMPGBKDVTSJY-UHFFFAOYSA-N)
| Basic Metabolism Top (代謝トップ) |
Molecule Index (化合物索引) |
EC classes ( EC分類) |
Input New Data (新規入力) |
Upper classes : BM Basic Metabolites : BMMC mono- or assembled cycle 単、複合環 : BMMCBZ benzene ring ベンゼン環 : BMMCBZ1S 0-1 substitution (53 pages)
| IDs and Links | |
|---|---|
| LipidBank | [1] |
| LipidMaps | [2] |
| CAS | 156-06-9 |
| KEGG | C00166 |
| KNApSAcK | |
| CDX file | |
| MOL file | BMMCBZ1Sj049.mol |
| Phenyl-pyruvic acid | |
|---|---|
| |
| Structural Information | |
| Systematic Name | 2-Oxo-3-phenylpropanoic acid |
| Common Name |
|
| Symbol | |
| Formula | C9H8O3 |
| Exact Mass | 164.0473 |
| Average Mass | 164.158 |
| SMILES | OC(=O)C(=O)Cc(c1)cccc1 |
| Physicochemical Information | |
| Melting Point | |
| Boiling Point | |
| Density | |
| Optical Rotation | |
| Reflactive Index | |
| Solubility | |
| Spectral Information | |
| Mass Spectra | |
| UV Spectra | |
| IR Spectra | |
| NMR Spectra | |
| Chromatograms | |
Related Atomic Mappings, Enzymes, and Pathways
- D-Phenylalanine ⇔ this
- (2S) -2-Amino-3-phenylpropanoic acid ⇔ this
- 4-Hydroxy-1- (3-hydroxy-2,3-dioxopropyl) cyclohexa-2,5-diene-1-carboxylic acid ⇔ this
- this ⇔ (Z) -2-Hydroxy-3-phenylprop-2-enoic acid
- this ⇔ Phenyl-acetaldehyde
- this ⇔ 2- (2-Hydroxyphenyl) acetic acid
- Phenyl-lactic acid ⇔ this
- CO2 ⇔ this
